CID 15580818

4-(2-methyl-1,3-dioxolan-2-yl)butan-1-amine

Structural Information

Molecular Formula
C8H17NO2
SMILES
CC1(OCCO1)CCCCN
InChI
InChI=1S/C8H17NO2/c1-8(4-2-3-5-9)10-6-7-11-8/h2-7,9H2,1H3
InChIKey
ZCUJMFCFOODBGV-UHFFFAOYSA-N
Compound name
4-(2-methyl-1,3-dioxolan-2-yl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

159.12593 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.13321 135.5
[M+Na]+ 182.11515 144.1
[M+NH4]+ 177.15975 144.8
[M+K]+ 198.08909 139.5
[M-H]- 158.11865 139.2
[M+Na-2H]- 180.10060 139.7
[M]+ 159.12538 137.7
[M]- 159.12648 137.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe